B7QKP5 -OEChem-04012113593D 35 35 0 1 0 0 0 0 0999 V2000 4.9409 1.6310 0.1378 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7470 0.2485 -0.7113 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.7518 -0.3356 0.8225 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.9854 1.6964 1.0439 F 0 0 0 0 0 0 0 0 0 0 0 0 -6.1660 1.1607 -0.7105 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.8296 -0.0360 0.6157 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6315 -0.6456 -1.5400 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4058 2.3217 1.3244 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3119 2.3556 -0.9493 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0087 -1.0006 -1.3974 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2524 1.4232 -1.4008 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9378 0.3197 0.5747 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5502 -1.7147 0.3489 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1046 -1.2632 0.4206 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4172 -0.6618 -0.3326 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6849 -3.0748 -0.3385 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5180 -1.0791 1.6589 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4087 -1.0475 -0.7544 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5321 -0.4415 0.5507 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8123 -0.6646 1.7245 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9216 -0.6330 -0.6887 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3130 0.7322 -0.5442 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2175 0.7092 0.1453 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9408 -1.8486 1.3671 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7298 -3.4050 -0.3292 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3667 -3.0475 -1.3865 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0849 -3.8350 0.1737 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0682 -1.2490 2.5796 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8683 -1.1895 -1.7278 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7829 0.1784 1.5813 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2826 -0.5166 2.6928 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4246 -0.4765 -1.6359 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6888 0.0334 0.2057 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0102 0.2124 -1.4529 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0941 1.4564 -0.7886 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 2 0 0 0 0 1 9 2 0 0 0 0 1 12 1 0 0 0 0 1 22 1 0 0 0 0 2 6 1 0 0 0 0 2 10 2 0 0 0 0 2 11 2 0 0 0 0 2 23 1 0 0 0 0 3 23 1 0 0 0 0 4 23 1 0 0 0 0 5 23 1 0 0 0 0 6 19 1 0 0 0 0 7 15 2 0 0 0 0 12 15 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 13 24 1 0 0 0 0 14 17 2 0 0 0 0 14 18 1 0 0 0 0 16 25 1 0 0 0 0 16 26 1 0 0 0 0 16 27 1 0 0 0 0 17 20 1 0 0 0 0 17 28 1 0 0 0 0 18 21 2 0 0 0 0 18 29 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 20 31 1 0 0 0 0 21 32 1 0 0 0 0 22 33 1 0 0 0 0 22 34 1 0 0 0 0 22 35 1 0 0 0 0 M END $$$$